(1S)-14-(4,4-Dichloropentyl)-18-(2-Hydroxy-2-Propanyl)-7-Isopropyl-15,15-Dimethyl-13,17-Dioxa-9,20-Dithia-3,6,22,23-Tetraazatricyclo[17.2.1.1~8,11~]Tricosa-8(23),10,19(22)-Triene-2,5,12,16-Tetrone
Properties
| Property | Value |
|---|---|
| Formula | C28H40Cl2N4O7S2 |
| IUPAC Name | (1s)-14-(4,4-dichloropentyl)-18-(2-hydroxy-2-propanyl)-7-isopropyl-15,15-dimethyl-13,17-dioxa-9,20-dithia-3,6,22,23-tetraazatricyclo[17.2.1.1 8,11 ]tricosa-8(23),10,19(22)-triene-2,5,12,16-tetrone |
| Molecular Mass | 679.676 g·mol−1 |
| Heat of Formation | -1376.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.33 ± 1.08 D |
| Volume | 768.95 Å 3 |
| Surface Area | 539.82 Å 2 |
| HOMO Energy | -9.10 ± 0.55 eV |
| LUMO Energy | 1.81 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | XZRCVAJXDSWDNB-LQJIQPLVSA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C Cl H O N S |